SCHEMBL2596993

SCHEMBL2596993

O=C(c1ccc(OC2CCN(C3CCN(c4ncc(Cl)cc4F)CC3)C2=O)c(F)c1)N1CC[C@@H](O)C1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.38
MDM2 Q00987 2/20 0.37
GPR6 P46095 4/20 0.36
LRRK2 Q5S007 2/20 0.36
CXCR3 P49682 1/20 0.36
KMT2A Q03164 2/20 0.35
PDE4B Q07343 1/20 0.35
RAB9A P51151 1/20 0.34
ABL1 P00519 2/20 0.34
GRM4 Q14833 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2597037 1.00 HPGD (0.38) HPGDMDM2GPR6LRRK2CXCR3
SCHEMBL15023136 1.00 HPGD (0.38) HPGDMDM2GPR6LRRK2CXCR3
SCHEMBL2596994 1.00 HPGD (0.38) HPGDMDM2GPR6LRRK2CXCR3
SCHEMBL15023685 1.00 HPGD (0.38) HPGDMDM2GPR6LRRK2CXCR3
SCHEMBL2597201 0.87 GPR6 (0.40) MDM2GPR6KMT2AGRM4
SCHEMBL2597200 0.87 GPR6 (0.40) MDM2GPR6KMT2AGRM4
SCHEMBL2597096 0.85 OPRK1 (0.41) GPR6KMT2AGRM4
SCHEMBL2597097 0.85 OPRK1 (0.41) GPR6KMT2AGRM4
SCHEMBL2597517 0.80 POLB (0.39) GPR6
SCHEMBL2597516 0.80 POLB (0.39) GPR6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571864-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-03-27 EP disclosed
WO-2011146335-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2011-11-24 WO disclosed